5-(3,4-dimethoxyphenyl)-2-(piperazin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-(piperazin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(3,4-dimethoxyphenyl)-2-(piperazin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3,4-dimethoxyphenyl)-2-(1-piperazinylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-(piperazin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(3,4-dimethoxyphenyl)-2-(piperazinomethyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CN4CCNCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CN4CCNCC4)OC

InChI

InChI=1S/C19H22N4O3S/c1-25-14-4-3-12(9-15(14)26-2)13-11-27-19-17(13)18(24)21-16(22-19)10-23-7-5-20-6-8-23/h3-4,9,11,20H,5-8,10H2,1-2H3,(H,21,22,24)